Information card for entry 7211843
| Formula |
C20 H13 N5 O4 Zn |
| Calculated formula |
C20 H13 N5 O4 Zn |
| Title of publication |
A case study of the ZnII-BDC/bpt mixed-ligand system: positional isomeric effect, structural diversification and luminescent properties |
| Authors of publication |
Huang, Fu-Ping; Tian, Jin-Lei; Chen, Gong-Jun; Li, Dong-Dong; Gu, Wen; Liu, Xin; Yan, Shi-Ping; Liao, Dai-Zheng; Cheng, Peng |
| Journal of publication |
CrystEngComm |
| Year of publication |
2010 |
| Journal volume |
12 |
| Journal issue |
4 |
| Pages of publication |
1269 |
| a |
8.485 ± 0.0017 Å |
| b |
9.878 ± 0.002 Å |
| c |
11.724 ± 0.002 Å |
| α |
89.78 ± 0.03° |
| β |
84.81 ± 0.03° |
| γ |
69.71 ± 0.03° |
| Cell volume |
917.5 ± 0.4 Å3 |
| Cell temperature |
293 ± 2 K |
| Ambient diffraction temperature |
293 ± 2 K |
| Number of distinct elements |
5 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0646 |
| Residual factor for significantly intense reflections |
0.0488 |
| Weighted residual factors for significantly intense reflections |
0.1128 |
| Weighted residual factors for all reflections included in the refinement |
0.1197 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.028 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/7211843.html
